2-azanyl-4-[4-[(4-chlorophenyl)methoxy]-3-nitro-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-[(4-chlorophenyl)methoxy]-3-nitro-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[4-[(4-chlorophenyl)methoxy]-3-nitro-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[4-[(4-chlorophenyl)methoxy]-3-nitrophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[4-[(4-chlorophenyl)methoxy]-3-nitrophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[4-(4-chlorobenzyl)oxy-3-nitro-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C25H22ClN3O5 MolecularWeight: 479.91228

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C25H22ClN3O5/c1-25(2)10-19(30)23-21(11-25)34-24(28)17(12-27)22(23)15-5-8-20(18(9-15)29(31)32)33-13-14-3-6-16(26)7-4-14/h3-9,22H,10-11,13,28H2,1-2H3